3-methyl-2-methylsulfanyl-7-[[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]quinazolin-4-one

Systemtic Name: 3-methyl-2-methylsulfanyl-7-[[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]quinazolin-4-one Openeye Name: 3-methyl-2-methylsulfanyl-7-[8-[3-(3-thienyl)prop-2-enoyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one CAS Name: 3-methyl-2-(methylthio)-7-[oxo-[8-[1-oxo-3-(3-thiophenyl)prop-2-enyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]-4-quinazolinone IUPAC Name: 3-methyl-2-methylsulfanyl-7-[8-(3-thiophen-3-ylprop-2-enoyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one Traditional Name: 3-methyl-2-(methylthio)-7-[8-[3-(3-thienyl)acryloyl]-3,8-diazaspiro[4.5]decane-3-carbonyl]quinazolin-4-one Formula: C26H28N4O3S2 MolecularWeight: 508.65552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC4(C3)CCN(CC4)C(=O)C=CC5=CSC=C5)N=C1SC

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC4(C3)CCN(CC4)C(=O)C=CC5=CSC=C5)N=C1SC

InChI

InChI=1S/C26H28N4O3S2/c1-28-24(33)20-5-4-19(15-21(20)27-25(28)34-2)23(32)30-13-10-26(17-30)8-11-29(12-9-26)22(31)6-3-18-7-14-35-16-18/h3-7,14-16H,8-13,17H2,1-2H3